N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide

C15H28N2O — CID 91365150

IUPACN-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide
SMILESC=CCN(CC(=O)NCCC1CC1C)CC(C)C
InChIInChI=1S/C15H28N2O/c1-5-8-17(10-12(2)3)11-15(18)16-7-6-14-9-13(14)4/h5,12-14H,1,6-11H2,2-4H3,(H,16,18)
InChIKeyKBKPYNOUYAPTCF-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.29
Rot. Bonds9

About N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide

N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide (PubChem CID 91365150) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide.

Molecular Properties

Compound NameN-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide
PubChem CID91365150
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide
SMILESC=CCN(CC(=O)NCCC1CC1C)CC(C)C
InChIInChI=1S/C15H28N2O/c1-5-8-17(10-12(2)3)11-15(18)16-7-6-14-9-13(14)4/h5,12-14H,1,6-11H2,2-4H3,(H,16,18)
InChIKeyKBKPYNOUYAPTCF-UHFFFAOYSA-N
XLogP2.29
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-[[2-[(1E)-1-fluorohexa-1,5-dien-3-yl]cyclopropyl]amino]-N,N-dipropylacetamide
CID 137402750
N-allyl-N'-(2-ethylhexyl)ethanediamide
CID 2917280
N1-allyl-N2-((1-methylpiperidin-4-yl)methyl)oxalamide
CID 16886496
N-(3-methylheptan-3-yl)-2-(prop-2-enylamino)acetamide
CID 139318689
N-(3-piperidin-4-ylpropyl)-N-prop-2-enylacetamide
CID 141886227
N'-[(2R)-2-ethylhexyl]-N-prop-2-enyloxamide
CID 2291577
N'-[(2S)-2-ethylhexyl]-N-prop-2-enyloxamide
CID 2291578
N-(cyclopropylmethyl)-2-(prop-2-enylamino)acetamide
CID 28563388
2-(cyclohexylmethylamino)-N-prop-2-enylpropanamide
CID 43216208
2-(cyclopentylmethylamino)-N-prop-2-enylpropanamide
CID 43317228
2-(4-methylpentan-2-ylamino)-N-prop-2-enylpropanamide
CID 43372164
2-(1-cyclopropylethylamino)-N-prop-2-enylpropanamide
CID 43401276

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide?
The IUPAC name of N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide (CID 91365150) is N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide.
What is the SMILES notation for N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide?
The canonical SMILES for N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide is C=CCN(CC(=O)NCCC1CC1C)CC(C)C.
What is the InChIKey of N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide?
The InChIKey is KBKPYNOUYAPTCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-5-8-17(10-12(2)3)11-15(18)16-7-6-14-9-13(14)4/h5,12-14H,1,6-11H2,2-4H3,(H,16,18).
What are the key properties of N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide?
N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide has a molecular weight of 252.40 g/mol, XLogP of 2.29, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylcyclopropyl)ethyl]-2-[2-methylpropyl(prop-2-enyl)amino]acetamide is sourced from PubChem (CID 91365150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).